2-[3-cyano-4-(3-ethoxy-4-phenylmethoxy-phenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[3-cyano-4-(3-ethoxy-4-phenylmethoxy-phenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-[[4-(4-benzyloxy-3-ethoxy-phenyl)-3-cyano-6-phenyl-2-pyridyl]sulfanyl]-N-(p-tolyl)acetamide CAS Name: 2-[[3-cyano-4-(3-ethoxy-4-phenylmethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[3-cyano-4-(3-ethoxy-4-phenylmethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[[4-(4-benzoxy-3-ethoxy-phenyl)-3-cyano-6-phenyl-2-pyridyl]thio]-N-(p-tolyl)acetamide Formula: C36H31N3O3S MolecularWeight: 585.71464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)C)C4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)C)C4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C36H31N3O3S/c1-3-41-34-20-28(16-19-33(34)42-23-26-10-6-4-7-11-26)30-21-32(27-12-8-5-9-13-27)39-36(31(30)22-37)43-24-35(40)38-29-17-14-25(2)15-18-29/h4-21H,3,23-24H2,1-2H3,(H,38,40)